Benzyl ferulate
TL;DR: Benzyl ferulate (CAS 132335-97-8) is a chemical compound with molecular formula C17H16O4 and molecular weight 284.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
Also Known As: benzyl ferulate, (E)-Benzyl ferulate, Benzyl (E)-Ferulate, benzyl (E)-p-coumarate, Ferulic acid benzyl ester
| Molecular Formula | C17H16O4 |
|---|---|
| Molecular Weight | 284.10 g/mol |
| LogP | 3.1574 |
| Topological Polar Surface Area | 55.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 284.10486 |
| Heavy Atoms | 21 |
| Complexity | 632.4933 |
Chemical Identifiers
| CAS Number | 132335-97-8 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)/C=C/C(=O)OCC2=CC=CC=C2)O |
Product Overview
Benzyl ferulate (CAS 132335-97-8), with molecular formula C17H16O4 and molecular weight 284.10 g/mol. IUPAC: benzyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate.
Chemical Property Profile of Benzyl ferulate
Property Insights of Benzyl ferulate
The XLogP value of 3.1574 indicates that Benzyl ferulate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.76 Ų, Benzyl ferulate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzyl ferulate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzyl ferulate?
The CAS number of Benzyl ferulate is 132335-97-8.
What is the molecular formula of Benzyl ferulate?
The molecular formula of Benzyl ferulate is C17H16O4.
What is the molecular weight of Benzyl ferulate?
The molecular weight of Benzyl ferulate is 284.10 g/mol.
Where can I buy Benzyl ferulate?
You can request a quote for Benzyl ferulate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl ferulate?
Yes, KEHONG BIO provides custom synthesis services for Benzyl ferulate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.